![CIS-2-(4-CHLOROPHENYL)-2-[3-(1-ALLYL-2-IMIDAZOLYL)-PROPYL]-4-BENZYLOXYMETHYL-1,3-DIOXOLANE](/api/spectrum/Lsoj6KENXnE/structure.png?h=300&w=458 "CIS-2-(4-CHLOROPHENYL)-2-[3-(1-ALLYL-2-IMIDAZOLYL)-PROPYL]-4-BENZYLOXYMETHYL-1,3-DIOXOLANE")
| SpectraBase Compound ID | 7mFFZr7t1w5 |
|---|---|
| InChI | InChI=1S/C26H29ClN2O3/c1-2-16-29-17-15-28-25(29)9-6-14-26(22-10-12-23(27)13-11-22)31-20-24(32-26)19-30-18-21-7-4-3-5-8-21/h2-5,7-8,10-13,15,17,24H,1,6,9,14,16,18-20H2/t24-,26-/m0/s1 |
| InChIKey | LJAUSQKSTYRZIR-AHWVRZQESA-N |
| Mol Weight | 452.98 g/mol |
| Molecular Formula | C26H29ClN2O3 |
| Exact Mass | 452.18667 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | Lsoj6KENXnE |
|---|---|
| Name | CIS-2-(4-CHLOROPHENYL)-2-[3-(1-ALLYL-2-IMIDAZOLYL)-PROPYL]-4-BENZYLOXYMETHYL-1,3-DIOXOLANE |
| Compound Number | 8A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C26H29ClN2O3 |
| InChI | InChI=1S/C26H29ClN2O3/c1-2-16-29-17-15-28-25(29)9-6-14-26(22-10-12-23(27)13-11-22)31-20-24(32-26)19-30-18-21-7-4-3-5-8-21/h2-5,7-8,10-13,15,17,24H,1,6,9,14,16,18-20H2/t24-,26-/m0/s1 |
| InChIKey | LJAUSQKSTYRZIR-AHWVRZQESA-N |
| Literature Reference Author | L.F.HUANG,L.BAUER |
| Literature Reference Citation | J.HETCYCL.CHEM.,34,1123(1997) |
| Literature Reference DOI | 10.1002/jhet.5570340405 |
| Molecular Weight | 452.981 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWSW776 |